GD154409

Name:

None

Formula:

C42H72O13

Smiles:

CCC(CCC(C)C1C(OC2OC(C(O)CO)C(O)C2O)CC2=C3C(OC4OC(C(O)COC)C(O)C4O)CC4CC(O)CCC4(C)C3CCC21C)C(C)C

Aglycone:

CCC(CCC(C)C1C(O)CC2=C3C(O)CC4CC(O)CCC4(C)C3CCC21C)C(C)C.COCCO

Sugarmoiety:

COCC(O)C1OC(O)C(O)C1O.OCOOC(O)C(O)O

Other Identifiers

• CNP0435933

AD00384

Formula: C3H8O2

Smiles:

COCCO

HBA:	2	RingCount:	0
HBD:	1	FractionCSP3:	1.0
AlogP:	-0.37	Num_rotatable_bonds:	2
MolWt:	76.09	Num_heavy_atoms:	5
TPSA:	29.46	NumAromaticRings:	0

AD61333

Formula: C29H50O3

Smiles:

CCC(CCC(C)C1C(O)CC2=C3C(O)CC4CC(O)CCC4(C)C3CCC21C)C(C)C

HBA:	3	RingCount:	4
HBD:	3	FractionCSP3:	0.93
AlogP:	6.11	Num_rotatable_bonds:	6
MolWt:	446.72	Num_heavy_atoms:	32
TPSA:	60.69	NumAromaticRings:	0